2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine

C10H10FN3O — CID 67052556

IUPAC2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine
SMILESCOc1ccc(-n2nccc2N)cc1F
InChIInChI=1S/C10H10FN3O/c1-15-9-3-2-7(6-8(9)11)14-10(12)4-5-13-14/h2-6H,12H2,1H3
InChIKeyYCOZKSKALGIBFL-UHFFFAOYSA-N
MW207.21 g/mol
LogP1.60
Rot. Bonds2

About 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine

2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine (PubChem CID 67052556) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine
PubChem CID67052556
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine
SMILESCOc1ccc(-n2nccc2N)cc1F
InChIInChI=1S/C10H10FN3O/c1-15-9-3-2-7(6-8(9)11)14-10(12)4-5-13-14/h2-6H,12H2,1H3
InChIKeyYCOZKSKALGIBFL-UHFFFAOYSA-N
XLogP1.60
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine (CID 67052556) is 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine is COc1ccc(-n2nccc2N)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine?
The InChIKey is YCOZKSKALGIBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-15-9-3-2-7(6-8(9)11)14-10(12)4-5-13-14/h2-6H,12H2,1H3.
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine?
2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine has a molecular weight of 207.21 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)pyrazol-3-amine is sourced from PubChem (CID 67052556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).